- InChI
- InChI=1S/C9H7NO/c11-9-5-1-4-8-7(9)3-2-6-10-8/h1-6,11H
- InChI Key
- GYESAYHWISMZOK-UHFFFAOYSA-N
- Formula
- C9H7NO
- SMILES
- Oc1cccc2ncccc12
- Molecular Weight1
- 145.16
- CAS
- 578-67-6
- Other Names
-
- 5-Hydroxyquinoline
- quinolin-5-ol
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5494 | Relay (1.0) Calculated Property | |
| ΔfG° | 96.36 | kJ/mol | Relay (1.0-beta) Calculated Property ⚠️ |
| ΔfH°gas | 8.83 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 77.27 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.12 | eV | Relay (1.0) Calculated Property |
| log10WS | [-2.54; -2.54] |
|
|
| log10WS | -2.54 | Aq. Solubility Prediction | |
| log10WS | -2.54 | Estimated Solubility | |
| logPoct/wat | 1.940 | Crippen Calculated Property | |
| McVol | 110.300 | ml/mol | McGowan Calculated Property |
| Pc | 5994.23 | kPa | Relay (1.0-beta) Calculated Property ⚠️ |
| Tboil | 555.39 | K | Relay (1.0) Calculated Property |
| Tc | 859.89 | K | Relay (1.0) Calculated Property |
| Tfus | 497.00 ± 3.00 | K | NIST |
| Vc | 0.396 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 5-Quinolinol.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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